N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-ethanoyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-acetyl-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-acetyl-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-acetyl-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-acetyl-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C19H16F2N2O4 MolecularWeight: 374.338146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

CC(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C19H16F2N2O4/c1-11(24)23-10-13-5-3-2-4-12(13)8-15(23)18(25)22-14-6-7-16-17(9-14)27-19(20,21)26-16/h2-7,9,15H,8,10H2,1H3,(H,22,25)